mp-531948/Ga6SnTe10/harm

Harmonic properties

../../_images/fig_bandos_pr9659.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos13501.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo9659.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc29420.png

(a) Force constants w.r.t atomic distance

Summary

../../_images/fig_times16798.png

(a) Computation time